SCHEMBL6679010

SCHEMBL6679010

N=C(N)NCCc1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ST14 Q9Y5Y6 2/20 0.50
GFER P55789 1/20 0.50
ESRRG P62508 1/20 0.47
IDO1 P14902 1/20 0.46
HIF1A Q16665 2/20 0.44
CYP3A4 P08684 2/20 0.44
NOS1 P29475 2/20 0.44
NPC1 O15118 1/20 0.44
CYP2D6 P10635 1/20 0.44
RAB9A P51151 1/20 0.44
MAOB P27338 4/20 0.43
MAOA P21397 2/20 0.43
BLM P54132 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PPID Q08752 1/20 0.40
MASP2 O00187 1/20 0.40
PLAU P00749 1/20 0.40
THPO P40225 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL8079626 0.98 ST14 (0.49) ST14GFERESRRGIDO1HIF1A
SCHEMBL23116506 0.89 MAOB (0.47) ST14GFERESRRGHIF1ACYP3A4
SCHEMBL23116515 0.87 MAOB (0.50) ST14GFERHIF1ACYP3A4NOS1
SCHEMBL12401907 0.86 ST14 (0.51) ST14IDO1HIF1ACYP3A4NOS1
SCHEMBL23116505 0.85 MAOB (0.48) ST14GFERHIF1ACYP3A4NOS1
SCHEMBL1286912 0.84 KDM4E (0.56) ST14GFERESRRGIDO1NPC1
SCHEMBL6682640 0.84 ST14 (0.50) ST14IDO1HIF1ACYP3A4NOS1
SCHEMBL6986416 0.83 ST14 (0.50) ST14GFERESRRGIDO1HIF1A
SCHEMBL18401315 0.82 ST14 (0.49) ST14IDO1HIF1ACYP3A4NOS1
SCHEMBL10310202 0.82 NPC1 (0.51) ST14IDO1NPC1RAB9ACA12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 76 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250144597-A1 CHROMATOGRAPHY RESIN HAVING AN ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE LIGAND BIO-RAD LABORATORIES, INC. 2025-05-08 US claimed
US-11666888-B2 Chromatography resin having an anionic exchange-hydrophobic mixed mode ligand BIO-RAD LABORATORIES, INC. (US) 2023-06-06 US claimed
EP-0932618-B1 PEPTIDE ANALOGUES CONTAINING A 7-MEMBERED LACTAM RING ASTRAZENECA AB (SE) 2003-12-10 EP claimed
EP-0946589-B1 INHIBITORS OF PEPTIDE BINDING TO MHC CLASS II PROTEINS ASTRAZENECA AB (SE) 2003-10-01 EP claimed
CN-1116305-C Peptide derivatives ZENECA LTD (GB) 2003-07-30 CN claimed
US-20020187934-A1 Peptide derivatives SYNGENTA LIMITED (GB) 2002-12-12 US claimed
US-6355617-B1 PEPTIDES, HYDROPHOBIC RESIDUES, AMINO ACIDS AND SEQUENCE SYNGENTA LIMITED (GB) 2002-03-12 US claimed
US-6207644-B1 FOR USE IN TREATING MHC CLASS II DEPENDENT T-CELL MEDIATED AUTOIMMUNE OR INFLAMMATORY DISEASES, SUCH AS RHEUMATOID ARTHRITIS ZENECA LIMITED (GB) 2001-03-27 US claimed
US-6184207-B1 A PEPTIDE INCLUDING SPECIFIED PIPERIDINE-CONTAINING GROUP, HAVING AN N-TERMINAL HYDROPHOBIC RESIDUE AND OPTIONALLY AN AMIDATED C-TERMINAL OF SPECIFIED END GROUPS; TREATING MULTIPLE SCLEROSIS OR RHEUMATOID ARTHRITIS ZENECA LIMITED (GB) 2001-02-06 US claimed
EP-0882066-B1 PEPTIDE DERIVATIVES ZENECA LTD (GB) 2000-09-06 EP claimed
US-6087336-A ANTIINFLAMMATORY AGENT TREATING RHEUMATOID ARTHRITIS ZENECA LIMITED (GB) 2000-07-11 US claimed
EP-0946589-A1 INHIBITORS OF PEPTIDE BINDING TO MHC CLASS II PROTEINS ZENECA LIMITED (GB) 1999-10-06 EP claimed
EP-0946596-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1999-10-06 EP claimed
EP-0932618-A1 PEPTIDE ANALOGUES CONTAINING A 7-MEMBERED LACTAM RING AstraZeneca AB (SE) 1999-08-04 EP claimed
CN-1213379-A Peptide derivatives ZENECA LTD (GB) 1999-04-07 CN claimed
EP-0882066-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1998-12-09 EP claimed
WO-1998025951-A1 INHIBITORS OF PEPTIDE BINDING TO MHC CLASS II PROTEINS ZENECA LIMITED (GB) 1998-06-18 WO claimed
WO-1998023644-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1998-06-04 WO claimed
WO-1998017680-A1 PEPTIDE ANALOGUES CONTAINING A 7-MEMBERED LACTAM RING ZENECA LIMITED (GB) 1998-04-30 WO claimed
WO-1997031023-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1997-08-28 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250144597-A1 CHROMATOGRAPHY RESIN HAVING AN ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE LIGAND MSR1, RXRA, MLX ST14 3448/4885GFER 2492/4885ESRRG 73/4885
US-11666888-B2 Chromatography resin having an anionic exchange-hydrophobic mixed mode ligand MSR1, RXRA, MLX ST14 3448/4885GFER 2492/4885ESRRG 73/4885
US-20020187934-A1 Peptide derivatives HLA-DRB1, MICA, TAP1 ST14 2297/4885GFER 4496/4885ESRRG 636/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.